Geometry & MOs

Info

ID:	311033
PubChem CID:	126588868
Reduced:	NF2O2C22H25 (1)
Stoich.:	AB2C2D22E25 (1)
Weight, g/mol:	363.130443
ΔH_f, kcal/mol:	-152.94
Dipole, Da:	5.42
IP(EA), eV:	-8.91(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-(fluoromethyl) N-[2-[(4-ethyl-2-methylphenoxy)methyl]-3-methoxyphenyl]carbamothioate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2NC(=O)CC)C3CC3)C(F)F

DOS

IR

Vibrations