Geometry & MOs

Info

ID:	310981
PubChem CID:	126588674
Reduced:	ClNO3C19H22 (1)
Stoich.:	ABC3D19E22 (1)
Weight, g/mol:	373.171165
ΔH_f, kcal/mol:	-114.34
Dipole, Da:	4.16
IP(EA), eV:	-8.16(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-ethyl N-[3-ethoxy-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]carbamothioate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2Cl)NC(=O)OCC)C

DOS

IR

Vibrations