Geometry & MOs

Info

ID:	210715
PubChem CID:	80844897
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	246.184447
ΔH_f, kcal/mol:	35.5
Dipole, Da:	4.03
IP(EA), eV:	-8.76(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cyclopropyl-4-N-(cyclopropylmethyl)-5-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1CNC2=NC=NC(=C2CC)N

DOS

IR

Vibrations