Geometry & MOs

Info

ID:	350089
PubChem CID:	127276962
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-6.15
Dipole, Da:	0.6
IP(EA), eV:	-8.47(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NOC(=N2)CN3CCCC3CN4CCCCC4

DOS

IR

Vibrations