Geometry & MOs

Info

ID:	407146
PubChem CID:	135079427
Reduced:	BrNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	387.08339
ΔH_f, kcal/mol:	-120.93
Dipole, Da:	4.55
IP(EA), eV:	-8.94(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-(2-bromo-4-phenylphenyl)-N-cyclohexylcarbamate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)N(C2CCCCC2)C(=O)OC)Br

DOS

IR

Vibrations