Geometry & MOs

Info

ID:	363311
PubChem CID:	127310728
Reduced:	OS2N6C17H24 (1)
Stoich.:	AB2C6D17E24 (1)
Weight, g/mol:	386.188881
ΔH_f, kcal/mol:	54.18
Dipole, Da:	9.18
IP(EA), eV:	-8.59(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(tetrazol-1-yl)-N-[(1-thiomorpholin-4-ylcyclohexyl)methyl]benzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)C2=C(C=CS2)N3C=NN=N3)N4CCSCC4

DOS

IR

Vibrations