Geometry & MOs

Info

ID:	145686
PubChem CID:	53571616
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	322.121195
ΔH_f, kcal/mol:	-16.41
Dipole, Da:	2.72
IP(EA), eV:	-9.2(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)OCCN1CCC2=CN=CN=C2C1

DOS

IR

Vibrations