Geometry & MOs

Info

ID:	397201
PubChem CID:	135029881
Reduced:	OSH16C19 (1)
Stoich.:	ABC16D19 (1)
Weight, g/mol:	368.116092
ΔH_f, kcal/mol:	28.14
Dipole, Da:	2.72
IP(EA), eV:	-8.39(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-oxo-1,3-diphenyl-3aH-chromeno[3,2-c]pyrazole-9a-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](C2=CC=CC=C2O)SC3=CC=CC=C3

DOS

IR

Vibrations