Geometry & MOs

Info

ID:	383345
PubChem CID:	134975016
Reduced:	SN2O2H18C19 (1)
Stoich.:	AB2C2D18E19 (1)
Weight, g/mol:	366.140199
ΔH_f, kcal/mol:	1.4
Dipole, Da:	5.31
IP(EA), eV:	-8.2(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,9R)-15-methyl-10-(4-methylphenyl)sulfonyl-8,10-diazatetracyclo[7.3.3.01,9.02,7]pentadeca-2,4,6,14-tetraene

Drug info:

PubChemData

Smile

C=C1CN(CCC2=C1NC3=CC=CC=C23)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations