Geometry & MOs

Info

ID:	203854
PubChem CID:	79883215
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	299.1333
ΔH_f, kcal/mol:	-10.73
Dipole, Da:	7.69
IP(EA), eV:	-9.15(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[4-[(cyclopropylamino)methyl]-2,6-difluorophenoxy]butanoate

Drug info:

PubChemData

Smile

CC(C1CCCC1)NC2=NC3=C(C=CC=C3O2)[N+](=O)[O-]

DOS

IR

Vibrations