Geometry & MOs

Info

ID:	272882
PubChem CID:	103763574
Reduced:	BrClNSO2C15H15 (1)
Stoich.:	ABCDE2F15G15 (1)
Weight, g/mol:	356.0291
ΔH_f, kcal/mol:	-39.28
Dipole, Da:	2.36
IP(EA), eV:	-9.36(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-chloro-N-(1-cyclopropylpiperidin-4-yl)benzamide

Drug info:

PubChemData

Smile

COCCN(CC1=CC=CS1)C(=O)C2=C(C=C(C=C2)Cl)Br

DOS

IR

Vibrations