Geometry & MOs

Info

ID:	267362
PubChem CID:	103582005
Reduced:	BrNOC13H16 (1)
Stoich.:	ABCD13E16 (1)
Weight, g/mol:	311.05209
ΔH_f, kcal/mol:	-44.19
Dipole, Da:	5.27
IP(EA), eV:	-8.59(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3,5-dimethylphenyl)-5-methyloxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NC(=O)C=C(C)C

DOS

IR

Vibrations