Geometry & MOs

Info

ID:	234899
PubChem CID:	92303675
Reduced:	N2O3C23H28 (1)
Stoich.:	A2B3C23D28 (1)
Weight, g/mol:	380.209993
ΔH_f, kcal/mol:	-89.87
Dipole, Da:	5.15
IP(EA), eV:	-8.38(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[(2S)-butan-2-yl]-3-(2,4-dimethoxyphenyl)-3-(1H-indol-3-yl)propanamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)C[C@@H](C1=C(C=C(C=C1)OC)OC)C2=CNC3=CC=CC=C32

DOS

IR

Vibrations