Geometry & MOs

Info

ID:	354071
PubChem CID:	127285870
Reduced:	O3N5C19H27 (1)
Stoich.:	A3B5C19D27 (1)
Weight, g/mol:	352.201159
ΔH_f, kcal/mol:	-97.2
Dipole, Da:	3.79
IP(EA), eV:	-8.78(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(cyclohexylmethyl)-1H-pyrazol-3-yl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NC2=NNC(=C2)CC3CCCCC3)C4CC4

DOS

IR

Vibrations