Geometry & MOs

Info

ID:	279163
PubChem CID:	103841784
Reduced:	BrClNOC13H15 (1)
Stoich.:	ABCDE13F15 (1)
Weight, g/mol:	342.01345
ΔH_f, kcal/mol:	-18.13
Dipole, Da:	4.93
IP(EA), eV:	-9.81(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CC(=C(C=C1)Cl)Br)C2CC2

DOS

IR

Vibrations