Geometry & MOs

Info

ID:	156806
PubChem CID:	56385730
Reduced:	N4O4H18C19 (1)
Stoich.:	A4B4C18D19 (1)
Weight, g/mol:	444.132136
ΔH_f, kcal/mol:	-31.79
Dipole, Da:	5.8
IP(EA), eV:	-8.64(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibenzofuran-2-yl 1-(3-methyl-4-nitrobenzoyl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC(=C2)CN3C(=NOC3=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations