Geometry & MOs

Info

ID:	404852
PubChem CID:	135071476
Reduced:	O4N5C12H23 (1)
Stoich.:	A4B5C12D23 (1)
Weight, g/mol:	403.145344
ΔH_f, kcal/mol:	-103.53
Dipole, Da:	3.12
IP(EA), eV:	-9.66(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[benzenesulfonyl(6-methylhept-5-en-2-yl)amino] phenyl carbonate

Drug info:

PubChemData

Smile

CCC(C(/C(=N/NC(=O)N)/C)C(=O)N(CC)CC)[N+](=O)[O-]

DOS

IR

Vibrations