Geometry & MOs

Info

ID:	194588
PubChem CID:	78559224
Reduced:	OSN4C14H24 (1)
Stoich.:	ABC4D14E24 (1)
Weight, g/mol:	364.12792
ΔH_f, kcal/mol:	-35.24
Dipole, Da:	6.43
IP(EA), eV:	-8.99(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(oxan-2-ylmethylsulfanyl)-11-propyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one

Drug info:

PubChemData

Smile

CC(C)C(C)NC(=O)CSC1=NN=C2N1CCCCC2

DOS

IR

Vibrations