Geometry & MOs

Info

ID:	365785
PubChem CID:	127318510
Reduced:	ON3C18H21 (1)
Stoich.:	AB3C18D21 (1)
Weight, g/mol:	320.163711
ΔH_f, kcal/mol:	-2.11
Dipole, Da:	4.27
IP(EA), eV:	-9.82(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-phenylcyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=NC=C1C(=O)NC2(CCCCC2)C3=CC=CC=C3

DOS

IR

Vibrations