Geometry & MOs

Info

ID:	224019
PubChem CID:	85337066
Reduced:	ON7C27H31 (1)
Stoich.:	AB7C27D31 (1)
Weight, g/mol:	470.231791
ΔH_f, kcal/mol:	94.29
Dipole, Da:	7.72
IP(EA), eV:	-8.51(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(dimethylamino)phenyl]methyl]-4-(1-nitroso-2,3-dihydroinden-5-ylidene)-5-piperidin-4-ylidenefuran-2-carboxamide

Drug info:

PubChemData

Smile

CCCCC1=CN(C(=O)N1CC2=NC=C(C=C2)C3=CC=CC=C3C4NNNN4)CC5=CC=CC=C5

DOS

IR

Vibrations