Geometry & MOs

Info

ID:	296085
PubChem CID:	117555516
Reduced:	N2C5H8 (2)
Stoich.:	A2B5C8 (2)
Weight, g/mol:	228.137497
ΔH_f, kcal/mol:	26.18
Dipole, Da:	1.87
IP(EA), eV:	-8.91(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-N-(2,3-dimethylphenyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CCC(C1)NCC2=NC=CC(=N2)N

DOS

IR

Vibrations