Geometry & MOs

Info

ID:	239986
PubChem CID:	93375486
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-152.03
Dipole, Da:	6.18
IP(EA), eV:	-9.13(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-3-[[4-(aminomethyl)benzoyl]-methylamino]-2-methylpropanoate

Drug info:

PubChemData

Smile

C[C@H](CN(C)C(=O)[C@@H]1CCCNC1)C(=O)OC

DOS

IR

Vibrations