Geometry & MOs

Info

ID:	286696
PubChem CID:	104222101
Reduced:	N4C17H30 (1)
Stoich.:	A4B17C30 (1)
Weight, g/mol:	276.231397
ΔH_f, kcal/mol:	-5.51
Dipole, Da:	1.48
IP(EA), eV:	-8.37(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-5-(ethylaminomethyl)-N-(2-methylpropyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1(CCN(C1)C2=NC=C(C=N2)CNC(C)(C)C)CC

DOS

IR

Vibrations