Geometry & MOs

Info

ID:	253042
PubChem CID:	103115668
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	208.132411
ΔH_f, kcal/mol:	23.65
Dipole, Da:	3.63
IP(EA), eV:	-9.03(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-aminopiperidin-1-yl)-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CNC1CCC(CC1)N(C)C(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations