Geometry & MOs

Info

ID:	76964
PubChem CID:	48425637
Reduced:	BrN2O3C16H23 (1)
Stoich.:	AB2C3D16E23 (1)
Weight, g/mol:	297.205242
ΔH_f, kcal/mol:	-123.59
Dipole, Da:	4.66
IP(EA), eV:	-9.0(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[[2-(2-oxoazocan-1-yl)acetyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCCOC1=CC=CC=C1Br

DOS

IR

Vibrations