Geometry & MOs

Info

ID:	233818
PubChem CID:	92098507
Reduced:	SN4O5C19H22 (1)
Stoich.:	AB4C5D19E22 (1)
Weight, g/mol:	390.155272
ΔH_f, kcal/mol:	-92.36
Dipole, Da:	6.06
IP(EA), eV:	-9.13(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-3-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

COC1=CN=CC(=N1)OC2CCC(CC2)NS(=O)(=O)CC3=NOC4=CC=CC=C43

DOS

IR

Vibrations