Geometry & MOs

Info

ID:	275916
PubChem CID:	103819082
Reduced:	ClINO2H13C16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	320.97673
ΔH_f, kcal/mol:	-33.66
Dipole, Da:	2.42
IP(EA), eV:	-9.49(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-chloro-N-(2-hydroxy-3-methoxypropyl)benzamide

Drug info:

PubChemData

Smile

C1[C@H]([C@H](C2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)Cl)I)O

DOS

IR

Vibrations