Geometry & MOs

Info

ID:	221301
PubChem CID:	85267548
Reduced:	NO3C25H31 (1)
Stoich.:	AB3C25D31 (1)
Weight, g/mol:	393.270151
ΔH_f, kcal/mol:	-79.71
Dipole, Da:	1.45
IP(EA), eV:	-9.16(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,5-dimethylhex-3-enyl)-2,4,6-tri(propan-2-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C2C3CCC(C3(C)C)(N(C2=O)OCC4=CC=CC=C4)C)O

DOS

IR

Vibrations