Geometry & MOs

Info

ID:	358120
PubChem CID:	127295665
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-98.15
Dipole, Da:	3.3
IP(EA), eV:	-8.88(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-pyrrolidin-1-ylazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC(C1)N2CCCC2)C(=O)N3CCOCC3

DOS

IR

Vibrations