Geometry & MOs

Info

ID:	363914
PubChem CID:	127313571
Reduced:	ON3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	235.168462
ΔH_f, kcal/mol:	-26.02
Dipole, Da:	4.61
IP(EA), eV:	-9.32(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,3-dimethylpiperidin-1-yl)-(1,5-dimethylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)N2CCCC(C2)(C)C

DOS

IR

Vibrations