Geometry & MOs

Info

ID:	234964
PubChem CID:	92303795
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	412.178693
ΔH_f, kcal/mol:	-92.23
Dipole, Da:	5.32
IP(EA), eV:	-7.99(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1,3-benzodioxol-4-yl)-3-(1H-indol-3-yl)-N-[(1R)-1-phenylethyl]propanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C[C@@H](C1=CC(=C(C=C1)OC)OC)C2=CNC3=C(C=CC=C23)CC

DOS

IR

Vibrations