Geometry & MOs

Info

ID:	234795
PubChem CID:	92303506
Reduced:	OCl2S2N3C17H21 (1)
Stoich.:	AB2C2D3E17F21 (1)
Weight, g/mol:	384.183778
ΔH_f, kcal/mol:	-6.13
Dipole, Da:	5.08
IP(EA), eV:	-8.82(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-benzyl-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCCC[C@H](CC)C(=O)NC1=NN=C(S1)SCC2=C(C=CC=C2Cl)Cl

DOS

IR

Vibrations