Geometry & MOs

Info

ID:	390414
PubChem CID:	134999047
Reduced:	NSO2C20H23 (1)
Stoich.:	ABC2D20E23 (1)
Weight, g/mol:	421.159551
ΔH_f, kcal/mol:	-39.96
Dipole, Da:	6.16
IP(EA), eV:	-9.09(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,3R,3aR,9bR)-2-methyl-1-naphthalen-1-yl-3-phenyl-3a,9b-dihydro-3H-benzo[g][2,1]benzazaphosphole 1-oxide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2(CCCC=C2C3=CC=CC=C3)C

DOS

IR

Vibrations