Geometry & MOs

Info

ID:

214744

PubChem CID:

85083570

Reduced:

N4O8C31H42 (1)

Stoich.:

A4B8C31D42 (1)

Weight, g/mol:

598.279135

ΔHf, kcal/mol:

-262.12

Dipole, Da:

5.82

IP(EA), eV:

 -9.29(-0.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(diaminomethylideneamino)-N-[5-hydroxy-4-methoxy-2-(naphthalen-2-ylmethoxy)-6-[(4-phenylphenyl)methoxymethyl]oxan-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)N(CCC(=O)NCCCCC(C(=O)OC)NC(=O)CCN(C(=O)C)OCC1=CC=CC=C1)OCC2=CC=CC=C2

DOS

IR

Vibrations