Geometry & MOs

Info

ID:	234987
PubChem CID:	92303836
Reduced:	N2O3C24H26 (1)
Stoich.:	A2B3C24D26 (1)
Weight, g/mol:	376.251464
ΔH_f, kcal/mol:	-75.4
Dipole, Da:	4.43
IP(EA), eV:	-8.57(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-butyl-3-(4-tert-butylphenyl)-3-(1H-indol-3-yl)propanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C[C@H](C2=CC3=C(C=C2)OCO3)C4=CNC5=CC=CC=C54

DOS

IR

Vibrations