Geometry & MOs

Info

ID:	252281
PubChem CID:	103110250
Reduced:	ON2C18H22 (1)
Stoich.:	AB2C18D22 (1)
Weight, g/mol:	300.119796
ΔH_f, kcal/mol:	-30.67
Dipole, Da:	3.48
IP(EA), eV:	-8.44(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-cyano-6-(trifluoromethyl)pyridin-2-yl]amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)CC(=O)NCC2=C(C(=CC=C2)N)C

DOS

IR

Vibrations