Geometry & MOs

Info

ID:	211459
PubChem CID:	80953294
Reduced:	ClON4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	265.134575
ΔH_f, kcal/mol:	-13.6
Dipole, Da:	2.37
IP(EA), eV:	-9.48(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(dicyclopropylmethyl)-2-propan-2-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC(=O)C(C)NC1=CC(=NC(=N1)C2CC2)Cl

DOS

IR

Vibrations