Geometry & MOs

Info

ID:	253922
PubChem CID:	103121532
Reduced:	O3N5C12H13 (1)
Stoich.:	A3B5C12D13 (1)
Weight, g/mol:	280.164774
ΔH_f, kcal/mol:	-46.3
Dipole, Da:	8.61
IP(EA), eV:	-10.37(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C(=C(N=N2)C(=O)O)CN)C(=O)N

DOS

IR

Vibrations