Geometry & MOs

Info

ID:	172108
PubChem CID:	75468062
Reduced:	Cl2N3O4H11C17 (1)
Stoich.:	A2B3C4D11E17 (1)
Weight, g/mol:	310.113984
ΔH_f, kcal/mol:	-72.42
Dipole, Da:	6.51
IP(EA), eV:	-9.04(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-methyl-N-(2-thiophen-2-ylethyl)naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)C3=C(N=CO3)C(=O)NC4=NC=C(C(=C4)Cl)Cl

DOS

IR

Vibrations