Geometry & MOs

Info

ID:	171936
PubChem CID:	75443560
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	301.146013
ΔH_f, kcal/mol:	-111.01
Dipole, Da:	5.24
IP(EA), eV:	-8.67(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-hydroxyethyl)cyclohexyl]methyl]-1-methylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CN1C=C(C=CC1=O)NC(=O)C(=O)NCCC2CC3CCC2C3

DOS

IR

Vibrations