Geometry & MOs

Info

ID:	417364
PubChem CID:	135092739
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	388.182064
ΔH_f, kcal/mol:	0.03
Dipole, Da:	4.44
IP(EA), eV:	-8.56(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-pentyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2CCCCC2)N3C[C@@H]4COC[C@H](C3)N(C4=O)C

DOS

IR

Vibrations