Geometry & MOs

Info

ID:	284597
PubChem CID:	104054707
Reduced:	ClON2C13H13 (1)
Stoich.:	ABC2D13E13 (1)
Weight, g/mol:	283.168462
ΔH_f, kcal/mol:	9.04
Dipole, Da:	5.54
IP(EA), eV:	-8.91(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-6-(4-methoxy-2,5-dimethylphenyl)-N-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)C)C2=NC(=NC=C2)Cl

DOS

IR

Vibrations