Geometry & MOs

Info

ID:	417187
PubChem CID:	135091590
Reduced:	ON2C18H28 (1)
Stoich.:	AB2C18D28 (1)
Weight, g/mol:	254.163043
ΔH_f, kcal/mol:	-57.36
Dipole, Da:	4.11
IP(EA), eV:	-8.03(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methylpropyl-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC[C@]1(CCC[C@H]2[C@@H]1CN(C2)C3=CC=CC(=N3)C(C)C)O

DOS

IR

Vibrations