Geometry & MOs

Info

ID:	79299
PubChem CID:	49747917
Reduced:	S2N4O5C23H26 (1)
Stoich.:	A2B4C5D23E26 (1)
Weight, g/mol:	410.195405
ΔH_f, kcal/mol:	-111.05
Dipole, Da:	4.55
IP(EA), eV:	-8.55(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N'-(2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)oxamide

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)C(=O)NC1=CC2=C(CCCN2S(=O)(=O)C3=CC=CS3)C=C1)C4=CC=CO4

DOS

IR

Vibrations