Geometry & MOs

Info

ID:	211431
PubChem CID:	80948964
Reduced:	OCl2N2C14H14 (1)
Stoich.:	AB2C2D14E14 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	-9.47
Dipole, Da:	4.41
IP(EA), eV:	-9.44(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-6-(2,4-dimethoxyphenyl)-N-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC2=CC(=NC(=N2)C(C)C)Cl)Cl

DOS

IR

Vibrations