Geometry & MOs

Info

ID:	311060
PubChem CID:	126589021
Reduced:	IN2O2C20H25 (1)
Stoich.:	AB2C2D20E25 (1)
Weight, g/mol:	359.155515
ΔH_f, kcal/mol:	-41.11
Dipole, Da:	3.05
IP(EA), eV:	-8.37(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2I)N(CC)C(=O)NC)C

DOS

IR

Vibrations