Geometry & MOs

Info

ID:	253100
PubChem CID:	103116044
Reduced:	ON6C14H18 (1)
Stoich.:	AB6C14D18 (1)
Weight, g/mol:	260.127326
ΔH_f, kcal/mol:	41.77
Dipole, Da:	3.71
IP(EA), eV:	-8.12(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminophenyl)-N-(2-hydroxyethyl)-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N2CCN(CC2)C3=CN=C(C=C3)N

DOS

IR

Vibrations