Geometry & MOs

Info

ID:	305606
PubChem CID:	124962004
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	264.158626
ΔH_f, kcal/mol:	-28.05
Dipole, Da:	3.82
IP(EA), eV:	-8.76(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N,N-dimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(C(=N1)[C@@H]2CCCN(C2)C(=O)C3=CC(=NO3)C4CCCCC4)C

DOS

IR

Vibrations