Geometry & MOs

Info

ID:	406975
PubChem CID:	135079045
Reduced:	BrNSO2C18H34 (1)
Stoich.:	ABCD2E18F34 (1)
Weight, g/mol:	305.14495
ΔH_f, kcal/mol:	-125.63
Dipole, Da:	6.88
IP(EA), eV:	-7.6(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohept-2-en-1-yl-4-methyl-N-prop-2-enylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CS(C)(C1C2CCC(C1OC)(C2(C)C)C)Br

DOS

IR

Vibrations