Geometry & MOs

Info

ID:	35595
PubChem CID:	7980079
Reduced:	N2O4C25H26 (1)
Stoich.:	A2B4C25D26 (1)
Weight, g/mol:	418.189257
ΔH_f, kcal/mol:	-103.33
Dipole, Da:	0.64
IP(EA), eV:	-7.88(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2,5-dimethoxy-4-[[(3R)-3-phenylbutanoyl]amino]phenyl]benzamide

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)NC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations