Geometry & MOs

Info

ID:	75187
PubChem CID:	48423139
Reduced:	BrNO2C17H22 (1)
Stoich.:	ABC2D17E22 (1)
Weight, g/mol:	329.04267
ΔH_f, kcal/mol:	-33.4
Dipole, Da:	4.68
IP(EA), eV:	-8.95(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2-fluorophenyl)methyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N(CC1=CC=CC=C1Br)C2CC2)OCC3CC3

DOS

IR

Vibrations