Geometry & MOs

Info

ID:	396509
PubChem CID:	135028603
Reduced:	NSO5C15H19 (1)
Stoich.:	ABC5D15E19 (1)
Weight, g/mol:	277.11365
ΔH_f, kcal/mol:	-186.69
Dipole, Da:	5.82
IP(EA), eV:	-9.91(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-(4,4-dimethylcyclohex-2-en-1-ylidene)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1(O[C@H]2[C@@H]3[C@@H](CO[C@H]([C@H]2O1)N3)S(=O)(=O)C4=CC=CC=C4)C

DOS

IR

Vibrations