Geometry & MOs

Info

ID:	216487
PubChem CID:	85086307
Reduced:	N3O3C14H15 (1)
Stoich.:	A3B3C14D15 (1)
Weight, g/mol:	273.157623
ΔH_f, kcal/mol:	-54.53
Dipole, Da:	10.62
IP(EA), eV:	-9.06(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonyl-pent-3-en-2-ylamino]acetate

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=CC(=C2)OC)NN=C(C)C(=O)O

DOS

IR

Vibrations