Geometry & MOs

Info

ID:	234766
PubChem CID:	92303457
Reduced:	NO2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	410.220557
ΔH_f, kcal/mol:	-128.85
Dipole, Da:	3.47
IP(EA), eV:	-8.11(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(2,4-dimethoxyphenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CCC1=C2C(=CC=C1)C(=CN2)[C@@H](CC(=O)NCCOC)C3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations