Geometry & MOs

Info

ID:	391194
PubChem CID:	135003501
Reduced:	NO3H17C20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	423.123736
ΔH_f, kcal/mol:	-48.7
Dipole, Da:	4.6
IP(EA), eV:	-9.33(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4-(4-chlorophenyl)-9-methyl-1-methylidene-3,4-dihydrocarbazole-2,2-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=C(C=C1C)C2=CC3=C(O2)C=CC(=C3)C#N)C

DOS

IR

Vibrations