Geometry & MOs

Info

ID:	84531
PubChem CID:	49867321
Reduced:	N3O5C12H19 (1)
Stoich.:	A3B5C12D19 (1)
Weight, g/mol:	216.102454
ΔH_f, kcal/mol:	-194.83
Dipole, Da:	4.74
IP(EA), eV:	-9.6(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(1S)-1-carboxy-2-naphthalen-2-ylethyl]azanium

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CON(C)C)O

DOS

IR

Vibrations