Geometry & MOs

Info

ID:	273894
PubChem CID:	103805695
Reduced:	OSBr2N2C9H10 (1)
Stoich.:	ABC2D2E9F10 (1)
Weight, g/mol:	349.96829
ΔH_f, kcal/mol:	1.31
Dipole, Da:	2.76
IP(EA), eV:	-9.34(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-iodo-N-pyrrolidin-3-ylbenzamide

Drug info:

PubChemData

Smile

C1CNCC1NC(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations