Geometry & MOs

Info

ID:	77382
PubChem CID:	48427392
Reduced:	NO2C20H21 (1)
Stoich.:	AB2C20D21 (1)
Weight, g/mol:	344.152478
ΔH_f, kcal/mol:	8.53
Dipole, Da:	3.81
IP(EA), eV:	-8.72(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylphenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)-N-prop-2-ynylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN(CC#C)C(=O)CC2=CC=CC=C2OC

DOS

IR

Vibrations