Geometry & MOs

Info

ID:

185606

PubChem CID:

77320055

Reduced:

N4O7C37H58 (1)

Stoich.:

A4B7C37D58 (1)

Weight, g/mol:

613.456705

ΔHf, kcal/mol:

-295.46

Dipole, Da:

7.63

IP(EA), eV:

 -8.24(0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(2-amino-3-methylbutanoyl)amino]-N-(cyclopropylmethyl)-4-hydroxy-7-[[3-(3-methoxypropyl)-1-methylindazol-5-yl]methyl]-8-methyl-2-propan-2-ylnonanamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)COCCOC)C(CN(CCC(C)(C)C(=O)NC)C(=O)C(C)N)OCC2=CC3=C(C=C2)OCCN3CCCOC

DOS

IR

Vibrations