Geometry & MOs

Info

ID:	199483
PubChem CID:	79253917
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	212.152478
ΔH_f, kcal/mol:	-46.59
Dipole, Da:	4.18
IP(EA), eV:	-8.86(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-3-methylbutan-1-ol

Drug info:

PubChemData

Smile

CC(C)C(CO)NC1CCCN(C1)CC2=CC=CC=C2

DOS

IR

Vibrations