Geometry & MOs

Info

ID:	354589
PubChem CID:	127287206
Reduced:	SO2N4C16H24 (1)
Stoich.:	AB2C4D16E24 (1)
Weight, g/mol:	281.119798
ΔH_f, kcal/mol:	-76.75
Dipole, Da:	4.57
IP(EA), eV:	-9.29(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyl-1,3-thiazol-5-yl)methyl]-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)N2CCC(CC2)C(=O)N3CCCC3

DOS

IR

Vibrations