Geometry & MOs

Info

ID:	429985
PubChem CID:	135170042
Reduced:	NSO2C8H9 (2)
Stoich.:	ABC2D8E9 (2)
Weight, g/mol:	193.110279
ΔH_f, kcal/mol:	-111.6
Dipole, Da:	4.5
IP(EA), eV:	-8.27(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(methylamino)-2-phenylethoxy]acetaldehyde

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)NC2=C(C=C(C=C2)N(C)C)SS(=O)(=O)O

DOS

IR

Vibrations