Geometry & MOs

Info

ID:	138447
PubChem CID:	52368387
Reduced:	O2N3C19H33 (1)
Stoich.:	A2B3C19D33 (1)
Weight, g/mol:	287.175953
ΔH_f, kcal/mol:	-84.81
Dipole, Da:	4.39
IP(EA), eV:	-8.9(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(3,5-dimethyl-1,2-oxazol-4-yl)methyl-[(4-methoxyphenyl)methyl]-prop-2-enylazanium

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CN(C1)C(C)(C)CNC(=O)C2=C(ON=C2C)C(C)C)C

DOS

IR

Vibrations