Geometry & MOs

Info

ID:	403773
PubChem CID:	135061787
Reduced:	N3C32H41 (1)
Stoich.:	A3B32C41 (1)
Weight, g/mol:	449.061233
ΔH_f, kcal/mol:	74.82
Dipole, Da:	1.49
IP(EA), eV:	-7.64(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-chloro-8-[(4-fluorophenyl)sulfonylamino]-8,9-dihydropyrido[3,2-b]indolizin-5-yl]acetate

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)[N+]2=CC(=[N+](N2)C3=C(C=CC=C3C(C)C)C(C)C)C4=CC=CC=C4

DOS

IR

Vibrations