Geometry & MOs

Info

ID:	343052
PubChem CID:	127266225
Reduced:	O2F3N3C12H18 (1)
Stoich.:	A2B3C3D12E18 (1)
Weight, g/mol:	309.168856
ΔH_f, kcal/mol:	-211.43
Dipole, Da:	4.93
IP(EA), eV:	-10.0(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-methyl-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]-4-oxobut-2-enyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CNC(=O)[C@H](C(C)C)NCC(F)(F)F

DOS

IR

Vibrations