Geometry & MOs

Info

ID:	233813
PubChem CID:	92098502
Reduced:	SO4N5C16H23 (1)
Stoich.:	AB4C5D16E23 (1)
Weight, g/mol:	423.194026
ΔH_f, kcal/mol:	-107.51
Dipole, Da:	11.01
IP(EA), eV:	-9.11(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(6-methoxypyrazin-2-yl)oxycyclohexyl]-3,5-dimethyl-1-propan-2-ylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NC2CCC(CC2)OC3=NC(=CN=C3)OC

DOS

IR

Vibrations