Geometry & MOs

Info

ID:	405128
PubChem CID:	135072655
Reduced:	NSO2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	381.17625
ΔH_f, kcal/mol:	-31.92
Dipole, Da:	4.53
IP(EA), eV:	-8.18(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(3-methyl-2-methylidenebut-3-enyl)-N-[(E)-4-phenylbut-3-enyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)[S@@](=O)N[C@@H](C[C@@H]1CO1)C2=CC=CC=C2

DOS

IR

Vibrations