Geometry & MOs

Info

ID:	396296
PubChem CID:	135028013
Reduced:	O5C18H22 (1)
Stoich.:	A5B18C22 (1)
Weight, g/mol:	283.120843
ΔH_f, kcal/mol:	-159.99
Dipole, Da:	4.96
IP(EA), eV:	-8.26(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-4-(1,3-dioxolan-2-yl)benzamide

Drug info:

PubChemData

Smile

CCOC1=CC(=O)[C@](CC1)(CC=O)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations