Geometry & MOs

Info

ID:	269789
PubChem CID:	103619037
Reduced:	BrNO2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	348.97304
ΔH_f, kcal/mol:	-50.04
Dipole, Da:	3.59
IP(EA), eV:	-9.19(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(cyclopropylmethyl)-2-iodo-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CC1CC1)C(=O)C2=C(C=CC(=C2)Br)O

DOS

IR

Vibrations