Geometry & MOs

Info

ID:	311313
PubChem CID:	126590394
Reduced:	SN2O2C21H26 (1)
Stoich.:	AB2C2D21E26 (1)
Weight, g/mol:	356.155849
ΔH_f, kcal/mol:	-35.76
Dipole, Da:	8.23
IP(EA), eV:	-8.06(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methoxyethyl-[(2-methylphenyl)methyl]carbamothioyl]-2-phenylacetamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1CN(CCOC)C(=S)NC(=O)CC2=CC=CC=C2

DOS

IR

Vibrations