Geometry & MOs

Info

ID:	310884
PubChem CID:	126588358
Reduced:	FNO3C19H22 (1)
Stoich.:	ABC3D19E22 (1)
Weight, g/mol:	429.02372
ΔH_f, kcal/mol:	-149.88
Dipole, Da:	4.3
IP(EA), eV:	-8.92(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[2-[(4-ethyl-2-fluorophenoxy)methyl]-3-iodophenyl]carbamate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2NC(=O)OC)CC)F

DOS

IR

Vibrations