Geometry & MOs

Info

ID:	130138
PubChem CID:	51075027
Reduced:	OSN5C14H17 (1)
Stoich.:	ABC5D14E17 (1)
Weight, g/mol:	249.184112
ΔH_f, kcal/mol:	30.94
Dipole, Da:	2.57
IP(EA), eV:	-8.97(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,1,5-trimethyl-N-(4-methylcyclohexyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=NC=CS2)C(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations