Geometry & MOs

Info

ID:	310837
PubChem CID:	126588104
Reduced:	NSO2C19H23 (1)
Stoich.:	ABC2D19E23 (1)
Weight, g/mol:	379.141756
ΔH_f, kcal/mol:	-46.43
Dipole, Da:	3.56
IP(EA), eV:	-8.73(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-methyl N-[2-[(2,4-diethylphenoxy)methyl]-3-(difluoromethyl)phenyl]carbamothioate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=CC=CC=C2NC(=S)OC)CC

DOS

IR

Vibrations