Geometry & MOs

Info

ID:	198136
PubChem CID:	79054407
Reduced:	FN2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	270.128075
ΔH_f, kcal/mol:	-34.22
Dipole, Da:	4.4
IP(EA), eV:	-8.92(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-cyclopropylimidazol-4-yl)-2-(3-fluoro-5-methylanilino)acetonitrile

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)NC(CC(C)(C)C)C#N

DOS

IR

Vibrations