Geometry & MOs

Info

ID:	234771
PubChem CID:	92303464
Reduced:	SN2O2H24C25 (1)
Stoich.:	AB2C2D24E25 (1)
Weight, g/mol:	394.225643
ΔH_f, kcal/mol:	-26.63
Dipole, Da:	6.65
IP(EA), eV:	-8.92(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(3,4-dimethoxyphenyl)-3-(1H-indol-3-yl)-N-pentylpropanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)[C@H]3N(C(=O)CS3)C4=CC=CC(=C4)C

DOS

IR

Vibrations