Geometry & MOs

Info

ID:	37059
PubChem CID:	8016454
Reduced:	N2O4H18C21 (1)
Stoich.:	A2B4C18D21 (1)
Weight, g/mol:	420.168522
ΔH_f, kcal/mol:	-98.83
Dipole, Da:	8.99
IP(EA), eV:	-9.05(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,8-dimethyl-2-oxochromen-7-yl)oxy-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(OC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)NC4=CN=CC=C4)C)C

DOS

IR

Vibrations