Geometry & MOs

Info

ID:	349187
PubChem CID:	127274913
Reduced:	SN2O3C20H30 (1)
Stoich.:	AB2C3D20E30 (1)
Weight, g/mol:	383.166748
ΔH_f, kcal/mol:	-127.23
Dipole, Da:	6.11
IP(EA), eV:	-9.46(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-oxo-N-[(1-phenylcycloheptyl)methyl]-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)(CNC(=O)CN2CCS(=O)(=O)CC2)C3=CC=CC=C3

DOS

IR

Vibrations