Geometry & MOs

Info

ID:	82793
PubChem CID:	49856538
Reduced:	NO3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	297.136493
ΔH_f, kcal/mol:	-95.58
Dipole, Da:	2.97
IP(EA), eV:	-9.37(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-benzamido-3-(3-methylphenyl)propanoate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(CC(=O)OC)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations