Geometry & MOs

Info

ID:	348855
PubChem CID:	127274503
Reduced:	O2N3C10H15 (1)
Stoich.:	A2B3C10D15 (1)
Weight, g/mol:	367.156577
ΔH_f, kcal/mol:	-48.64
Dipole, Da:	3.02
IP(EA), eV:	-9.6(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1,4-oxazepan-4-yl)-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)C2=CC=NN2

DOS

IR

Vibrations