Geometry & MOs

Info

ID:	197717
PubChem CID:	78988597
Reduced:	BrNO3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	325.06774
ΔH_f, kcal/mol:	-115.69
Dipole, Da:	2.77
IP(EA), eV:	-9.39(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(cyclopentylmethyl)-2-methoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CCCCOCCNC(=O)C1=C(C=C(C=C1)Br)OC

DOS

IR

Vibrations