Geometry & MOs

Info

ID:	278875
PubChem CID:	103839351
Reduced:	BrClNO2C11H11 (1)
Stoich.:	ABCD2E11F11 (1)
Weight, g/mol:	278.106671
ΔH_f, kcal/mol:	-69.11
Dipole, Da:	1.77
IP(EA), eV:	-9.91(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-cyclopropylcyclopropyl)methyl]-5-fluoro-2-nitrobenzamide

Drug info:

PubChemData

Smile

C1COCC1NC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations