Geometry & MOs

Info

ID:	139151
PubChem CID:	52483024
Reduced:	N3O5C15H21 (1)
Stoich.:	A3B5C15D21 (1)
Weight, g/mol:	380.077514
ΔH_f, kcal/mol:	-122.45
Dipole, Da:	10.33
IP(EA), eV:	-8.83(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[methyl(propan-2-yl)amino]-2-oxoethyl] 5-(2-chloro-4-nitrophenyl)furan-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)N(C)C(=O)COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N(C)C

DOS

IR

Vibrations