Geometry & MOs

Info

ID:	233800
PubChem CID:	92098489
Reduced:	SN4O5C20H26 (1)
Stoich.:	AB4C5D20E26 (1)
Weight, g/mol:	448.178041
ΔH_f, kcal/mol:	-168.28
Dipole, Da:	12.25
IP(EA), eV:	-9.12(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[4-(6-methoxypyrazin-2-yl)oxycyclohexyl]sulfamoyl]-3-methylphenyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)C)S(=O)(=O)NC2CCC(CC2)OC3=NC(=CN=C3)OC

DOS

IR

Vibrations