Geometry & MOs

Info

ID:	166017
PubChem CID:	74626519
Reduced:	N3O7C23H25 (1)
Stoich.:	A3B7C23D25 (1)
Weight, g/mol:	349.158589
ΔH_f, kcal/mol:	-252.03
Dipole, Da:	8.03
IP(EA), eV:	-9.05(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-1-thiophen-3-ylethyl]-dimethylazanium

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CC2COC3=CC=CC=C3O2)C)C(=O)COC(=O)CCC4C(=O)NC(=O)N4

DOS

IR

Vibrations