Geometry & MOs

Info

ID:	362439
PubChem CID:	127307785
Reduced:	OSN2C7H7 (2)
Stoich.:	ABC2D7E7 (2)
Weight, g/mol:	387.125277
ΔH_f, kcal/mol:	14.95
Dipole, Da:	3.43
IP(EA), eV:	-8.94(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-hydroxybenzoyl)pyrrolidin-2-yl]-[2-(1,3-thiazol-2-yl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CC2=CN3C=CSC3=N2)C4=NC=CS4

DOS

IR

Vibrations