Geometry & MOs

Info

ID:	403625
PubChem CID:	135061072
Reduced:	NO2C19H19 (1)
Stoich.:	AB2C19D19 (1)
Weight, g/mol:	380.225249
ΔH_f, kcal/mol:	-17.34
Dipole, Da:	3.83
IP(EA), eV:	-8.74(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-methyl-11,13-bis(4-methylphenyl)-1,10-diazatricyclo[7.4.1.05,14]tetradeca-5(14),6,8,10-tetraene

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2[C@@](C1=O)(CC=C)C3=CC(=CC=C3)OC

DOS

IR

Vibrations