Geometry & MOs

Info

ID:	199555
PubChem CID:	79266690
Reduced:	N2O3C13H18 (1)
Stoich.:	A2B3C13D18 (1)
Weight, g/mol:	271.178358
ΔH_f, kcal/mol:	-123.99
Dipole, Da:	4.02
IP(EA), eV:	-9.7(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl-[3-(oxan-2-yl)propanoyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)C(=O)N(CC(=O)O)C(C)(C)C

DOS

IR

Vibrations