Geometry & MOs

Info

ID:	295736
PubChem CID:	117543474
Reduced:	N3O3C11H13 (1)
Stoich.:	A3B3C11D13 (1)
Weight, g/mol:	265.106256
ΔH_f, kcal/mol:	-56.04
Dipole, Da:	5.35
IP(EA), eV:	-8.18(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-4-(3,4,5-trimethoxyphenyl)-1,2-dihydropyrazol-3-one

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C2=C(NNC2=O)N

DOS

IR

Vibrations