Geometry & MOs

Info

ID:	271640
PubChem CID:	103686806
Reduced:	NF3O4C14H22 (1)
Stoich.:	AB3C4D14E22 (1)
Weight, g/mol:	261.090212
ΔH_f, kcal/mol:	-379.59
Dipole, Da:	3.8
IP(EA), eV:	-10.14(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dicyanophenyl)-2-methylbenzamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C)C1(CCCC(C1)C(F)(F)F)C(=O)O

DOS

IR

Vibrations