Geometry & MOs

Info

ID:	196240
PubChem CID:	78800486
Reduced:	BrNO2C15H24 (1)
Stoich.:	ABC2D15E24 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-145.16
Dipole, Da:	4.22
IP(EA), eV:	-9.94(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-acetyl-2-methoxyphenyl)-N-(3-hydroxypropyl)acetamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CC12CC3CC(C1)CC(C3)(C2)Br)O

DOS

IR

Vibrations