Geometry & MOs

Info

ID:	202201
PubChem CID:	79641549
Reduced:	N2O3C13H26 (1)
Stoich.:	A2B3C13D26 (1)
Weight, g/mol:	281.246713
ΔH_f, kcal/mol:	-147.33
Dipole, Da:	4.27
IP(EA), eV:	-8.65(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(ethylamino)-3-(4-methylazepan-1-yl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CCOC)C1CCCC(C1)(C(=O)O)NC

DOS

IR

Vibrations