Geometry & MOs

Info

ID:	419529
PubChem CID:	135108349
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-43.1
Dipole, Da:	4.43
IP(EA), eV:	-9.38(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,8aS)-7-[3-(1H-indol-3-yl)propanoyl]-1-methyl-3,4,5,6,8,8a-hexahydro-2H-1,7-naphthyridine-4a-carboxylic acid

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)C2CC23CC3)C(=O)C4CC=CC4

DOS

IR

Vibrations