Geometry & MOs

Info

ID:	448660
PubChem CID:	135292592
Reduced:	ClON2C18H21 (1)
Stoich.:	ABC2D18E21 (1)
Weight, g/mol:	278.210661
ΔH_f, kcal/mol:	25.85
Dipole, Da:	2.33
IP(EA), eV:	-8.92(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[3-methylpentyl(propyl)amino]pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC1C=CC=C2C1(C(=O)N(C(=N2)CCl)C3CC=CC=C3C)C

DOS

IR

Vibrations