Geometry & MOs

Info

ID:	421059
PubChem CID:	135115299
Reduced:	ON3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	374.198777
ΔH_f, kcal/mol:	-33.56
Dipole, Da:	4.27
IP(EA), eV:	-8.99(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(1,4-dimethylpiperidine-4-carbonyl)-1,4-diazepan-1-yl]-2-oxoethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCCC1CCCN1CC2=NC=CN2CCOC

DOS

IR

Vibrations