Geometry & MOs

Info

ID:	357971
PubChem CID:	127295485
Reduced:	N2O4C21H30 (1)
Stoich.:	A2B4C21D30 (1)
Weight, g/mol:	308.130697
ΔH_f, kcal/mol:	-164.86
Dipole, Da:	2.1
IP(EA), eV:	-8.22(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-2-[[methyl(oxan-3-ylmethyl)amino]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)CC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

DOS

IR

Vibrations