Geometry & MOs

Info

ID:	264276
PubChem CID:	103449625
Reduced:	NOC6H9 (2)
Stoich.:	ABC6D9 (2)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	-76.08
Dipole, Da:	4.3
IP(EA), eV:	-9.67(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-hydroxycyclohexyl)-(1-propylimidazol-2-yl)methanone

Drug info:

PubChemData

Smile

CCN1C=CN=C1C(=O)C2(CCCCC2)O

DOS

IR

Vibrations