Geometry & MOs

Info

ID:	445239
PubChem CID:	135265364
Reduced:	ON2C19H30 (1)
Stoich.:	AB2C19D30 (1)
Weight, g/mol:	439.145344
ΔH_f, kcal/mol:	6.18
Dipole, Da:	3.0
IP(EA), eV:	-8.78(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[propan-2-yl(2-prop-2-enoyloxyethyl)amino]ethyl 9-oxothioxanthene-1-carboxylate

Drug info:

PubChemData

Smile

CCN(CCN(C)CCOC=C)CC1=CC=C(C=C1)C2CC2

DOS

IR

Vibrations