Geometry & MOs

Info

ID:	316142
PubChem CID:	126630200
Reduced:	N5C21H21 (1)
Stoich.:	A5B21C21 (1)
Weight, g/mol:	483.172896
ΔH_f, kcal/mol:	101.3
Dipole, Da:	2.6
IP(EA), eV:	-9.18(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-[2-(aminomethyl)-1,3-dihydroinden-2-yl]pyridin-4-yl]-3-methanimidoylpyridin-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2CC1(CN)C3=NC=CC(=C3)C4=C(C(=NC=C4)N)C=N

DOS

IR

Vibrations