Geometry & MOs

Info

ID:	399648
PubChem CID:	135041488
Reduced:	NSO3C15H19 (1)
Stoich.:	ABC3D15E19 (1)
Weight, g/mol:	311.05209
ΔH_f, kcal/mol:	-76.78
Dipole, Da:	5.81
IP(EA), eV:	-9.29(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-N-(2-methyl-4-oxopentan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC(=C)C2)C(=C)C

DOS

IR

Vibrations