Geometry & MOs

Info

ID:	358032
PubChem CID:	127295577
Reduced:	NC7H14 (2)
Stoich.:	AB7C14 (2)
Weight, g/mol:	369.152241
ΔH_f, kcal/mol:	-21.29
Dipole, Da:	2.03
IP(EA), eV:	-8.2(2.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-1-[4-(5-fluoropyridin-3-yl)sulfonyl-1,4-diazepan-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)CN1CCCCC(C1)N2CCCC2

DOS

IR

Vibrations