Geometry & MOs

Info

ID:	38646
PubChem CID:	8137326
Reduced:	BrFN2O2C14H14 (1)
Stoich.:	ABC2D2E14F14 (1)
Weight, g/mol:	341.118712
ΔH_f, kcal/mol:	-77.24
Dipole, Da:	4.05
IP(EA), eV:	-9.57(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-2-oxoethyl]-2-(difluoromethoxy)benzamide

Drug info:

PubChemData

Smile

C1CC1NC(=O)CNC(=O)/C=C/C2=C(C=CC(=C2)Br)F

DOS

IR

Vibrations