Geometry & MOs

Info

ID:	261265
PubChem CID:	103224550
Reduced:	N2O3C11H22 (1)
Stoich.:	A2B3C11D22 (1)
Weight, g/mol:	202.131742
ΔH_f, kcal/mol:	-135.52
Dipole, Da:	4.83
IP(EA), eV:	-8.92(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,4-diazepan-1-yl)-3-methoxypropanoic acid

Drug info:

PubChemData

Smile

CN(C)C1CCN(CC1)C(COC)C(=O)O

DOS

IR

Vibrations