Geometry & MOs

Info

ID:	235041
PubChem CID:	92303934
Reduced:	SN2O2H24C25 (1)
Stoich.:	AB2C2D24E25 (1)
Weight, g/mol:	382.181191
ΔH_f, kcal/mol:	-32.08
Dipole, Da:	5.06
IP(EA), eV:	-8.57(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-butyl-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2[C@H](SCC2=O)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4C)C

DOS

IR

Vibrations