Geometry & MOs

Info

ID:	207698
PubChem CID:	80439473
Reduced:	N3C17H23 (1)
Stoich.:	A3B17C23 (1)
Weight, g/mol:	257.164046
ΔH_f, kcal/mol:	21.51
Dipole, Da:	3.07
IP(EA), eV:	-8.94(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-cyclopropylimidazol-4-yl)-6-(2-methylpropyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C2=NC(=CC(=N2)NC)CC(C)C)C

DOS

IR

Vibrations