Geometry & MOs

Info

ID:	368091
PubChem CID:	127327467
Reduced:	ON4C17H28 (1)
Stoich.:	AB4C17D28 (1)
Weight, g/mol:	243.148396
ΔH_f, kcal/mol:	-27.62
Dipole, Da:	3.29
IP(EA), eV:	-8.82(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N,6-dimethyl-N-(1H-pyrazol-5-ylmethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1CCN(CC1)CC(CNC2=NC(=NC(=C2)C)C3CC3)O

DOS

IR

Vibrations