Geometry & MOs

Info

ID:	221167
PubChem CID:	85257107
Reduced:	NOH7C9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	290.141913
ΔH_f, kcal/mol:	18.17
Dipole, Da:	5.08
IP(EA), eV:	-9.26(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylphenyl)-[4-(2-phenylethenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C=C2C=CC=NC2=N1)C(=O)C=CC3=CC=C(C=C3)O

DOS

IR

Vibrations