Geometry & MOs

Info

ID:	285713
PubChem CID:	104121457
Reduced:	NC4H7 (3)
Stoich.:	AB4C7 (3)
Weight, g/mol:	222.184447
ΔH_f, kcal/mol:	2.98
Dipole, Da:	1.51
IP(EA), eV:	-8.29(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)NCC(C)C)CNC

DOS

IR

Vibrations