Geometry & MOs

Info

ID:	40819
PubChem CID:	8144751
Reduced:	SO2N4C16H24 (1)
Stoich.:	AB2C4D16E24 (1)
Weight, g/mol:	411.104148
ΔH_f, kcal/mol:	-80.49
Dipole, Da:	2.17
IP(EA), eV:	-8.83(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(2Z)-2-(1-naphthalen-1-ylethylidene)hydrazinyl]-1,3-thiazol-4-yl]chromen-2-one

Drug info:

PubChemData

Smile

CC[C@@H](C)CC1=C(SC2=C1C(=O)NC(=N2)CNCC(=O)NC)C

DOS

IR

Vibrations