Geometry & MOs

Info

ID:	201703
PubChem CID:	79569383
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	312.150764
ΔH_f, kcal/mol:	-79.18
Dipole, Da:	2.46
IP(EA), eV:	-8.8(2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2,6-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCNC1CCCCCC1COCC

DOS

IR

Vibrations