Geometry & MOs

Info

ID:	268100
PubChem CID:	103597871
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	362.126657
ΔH_f, kcal/mol:	-24.69
Dipole, Da:	4.06
IP(EA), eV:	-8.67(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[3-oxo-3-[(5-phenyl-1,3-oxazol-2-yl)methylamino]prop-1-enyl]benzoate

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CCCNC(=O)C=CC2=CN(C3=CC=CC=C32)CCC#N

DOS

IR

Vibrations