Geometry & MOs

Info

ID:	78034
PubChem CID:	49681577
Reduced:	SN3O3C18H21 (1)
Stoich.:	AB3C3D18E21 (1)
Weight, g/mol:	389.104542
ΔH_f, kcal/mol:	-96.34
Dipole, Da:	1.01
IP(EA), eV:	-9.17(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2-methoxycarbonylbenzoyl)amino]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)N1CCC2=C(C1)SC(=N2)NC(=O)CC3=CC=CC(=C3)C

DOS

IR

Vibrations