Geometry & MOs

Info

ID:	255389
PubChem CID:	103131711
Reduced:	OC5H10 (2)
Stoich.:	AB5C10 (2)
Weight, g/mol:	178.110613
ΔH_f, kcal/mol:	-132.42
Dipole, Da:	3.18
IP(EA), eV:	-9.53(2.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrazol-3-yl)cyclohexan-1-one

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(C)C(C)O

DOS

IR

Vibrations