Geometry & MOs

Info

ID:	430556
PubChem CID:	135170622
Reduced:	NOC9H13 (1)
Stoich.:	ABC9D13 (1)
Weight, g/mol:	218.066697
ΔH_f, kcal/mol:	6.04
Dipole, Da:	3.86
IP(EA), eV:	-9.93(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-methyl-4-(trifluoromethyl)pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CCC(=C)C

DOS

IR

Vibrations