Geometry & MOs

Info

ID:	58278
PubChem CID:	24434914
Reduced:	ON6C24H28 (1)
Stoich.:	AB6C24D28 (1)
Weight, g/mol:	442.180504
ΔH_f, kcal/mol:	84.89
Dipole, Da:	9.17
IP(EA), eV:	-8.43(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-N-[(E)-[3-(4-fluorobenzoyl)-2-methylindolizin-1-yl]methylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1/C=N/NC(=O)C2=CC(=CC=C2)N(C)C)N3CCCC3)C4=CC=CC=C4

DOS

IR

Vibrations