Geometry & MOs

Info

ID:	387092
PubChem CID:	134983953
Reduced:	O5N6C12H12 (1)
Stoich.:	A5B6C12D12 (1)
Weight, g/mol:	341.164046
ΔH_f, kcal/mol:	39.34
Dipole, Da:	6.54
IP(EA), eV:	-10.25(-2.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-2,5-diphenyl-4-(pyrrolidin-1-ylhydrazinylidene)pyrrole-3-carbonitrile

Drug info:

PubChemData

Smile

C1C[C@@H](C(C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])N=[N+]=[N-]

DOS

IR

Vibrations