Geometry & MOs

Info

ID:	368949
PubChem CID:	127330968
Reduced:	SO2N5C16H21 (1)
Stoich.:	AB2C5D16E21 (1)
Weight, g/mol:	344.130697
ΔH_f, kcal/mol:	-43.07
Dipole, Da:	6.47
IP(EA), eV:	-8.87(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-anilino-N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN2C=C(N=C2C1)CCNC(=O)NC3=NC4=C(S3)COCC4

DOS

IR

Vibrations