Geometry & MOs

Info

ID:	368141
PubChem CID:	127327678
Reduced:	SN3O3C21H25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	331.102434
ΔH_f, kcal/mol:	-77.26
Dipole, Da:	7.12
IP(EA), eV:	-8.79(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methyl-1,3-thiazol-4-yl)methyl]-4-morpholin-4-yl-1,1-dioxothiolan-3-amine

Drug info:

PubChemData

Smile

C[C@@H]1CN(CCN1S(=O)(=O)C2=CC3=C(CCNC3=O)C=C2)CC4=CC=CC=C4

DOS

IR

Vibrations