Geometry & MOs

Info

ID:	284306
PubChem CID:	104041586
Reduced:	ClSN2O4C12H15 (1)
Stoich.:	ABC2D4E12F15 (1)
Weight, g/mol:	275.1333
ΔH_f, kcal/mol:	-110.73
Dipole, Da:	4.22
IP(EA), eV:	-10.15(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(difluoromethoxy)phenyl]methyl]-2,3-dimethoxypropan-1-amine

Drug info:

PubChemData

Smile

COCC(CNS(=O)(=O)C1=CC(=C(C=C1)C#N)Cl)OC

DOS

IR

Vibrations