Geometry & MOs

Info

ID:	290767
PubChem CID:	110489960
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	441.172228
ΔH_f, kcal/mol:	-25.92
Dipole, Da:	5.23
IP(EA), eV:	-9.03(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-(dimethylcarbamoyl)-2-[(1-ethyl-3-methylindole-2-carbonyl)amino]-4-methylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

COC1=CC2=CC(=CN=C2C=C1)C(=O)N3CCNCC3

DOS

IR

Vibrations