Geometry & MOs

Info

ID:	179109
PubChem CID:	76435031
Reduced:	O2N7C13H13 (1)
Stoich.:	A2B7C13D13 (1)
Weight, g/mol:	367.167811
ΔH_f, kcal/mol:	94.32
Dipole, Da:	1.81
IP(EA), eV:	-9.54(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-methylthiadiazol-5-yl)methyl]-3-(3-morpholin-4-ylpropyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d][1,3]oxazol-2-one

Drug info:

PubChemData

Smile

CC(C1NC(=O)NN1)N2C=CN=C2C3=CC=CC4=NON=C43

DOS

IR

Vibrations