Geometry & MOs

Info

ID:	235218
PubChem CID:	92304233
Reduced:	N3O3C25H25 (1)
Stoich.:	A3B3C25D25 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	-36.53
Dipole, Da:	7.72
IP(EA), eV:	-8.38(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2,4-dimethoxyphenyl)-3-(1H-indol-3-yl)-N-(pyridin-4-ylmethyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)[C@@H](CC(=O)NCC2=CC=NC=C2)C3=CNC4=CC=CC=C43)OC

DOS

IR

Vibrations