Geometry & MOs

Info

ID:	267368
PubChem CID:	103582017
Reduced:	BrNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	325.06774
ΔH_f, kcal/mol:	-92.94
Dipole, Da:	2.53
IP(EA), eV:	-8.86(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3,5-dimethylphenyl)-2-(oxan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NC(=O)C2CCOCC2

DOS

IR

Vibrations