Geometry & MOs

Info

ID:	338107
PubChem CID:	127258799
Reduced:	NO2C23H37 (1)
Stoich.:	AB2C23D37 (1)
Weight, g/mol:	307.1606
ΔH_f, kcal/mol:	-124.76
Dipole, Da:	1.8
IP(EA), eV:	-8.95(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-4-methylsulfanylphenyl) N-[(E)-oct-1-enyl]carbamate

Drug info:

PubChemData

Smile

CCCCCC/C=C/NC(=O)OC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations