Geometry & MOs

Info

ID:	64479
PubChem CID:	29201410
Reduced:	N4O5C17H18 (1)
Stoich.:	A4B5C17D18 (1)
Weight, g/mol:	279.121906
ΔH_f, kcal/mol:	-29.08
Dipole, Da:	12.38
IP(EA), eV:	-9.03(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 2-(methylamino)benzoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations