Geometry & MOs

Info

ID:	295731
PubChem CID:	117543466
Reduced:	ON3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	205.085127
ΔH_f, kcal/mol:	6.21
Dipole, Da:	5.58
IP(EA), eV:	-8.56(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2=C(NNC2=O)N

DOS

IR

Vibrations