Geometry & MOs

Info

ID:	414474
PubChem CID:	135087432
Reduced:	SN2O4C17H26 (1)
Stoich.:	AB2C4D17E26 (1)
Weight, g/mol:	320.167083
ΔH_f, kcal/mol:	-171.43
Dipole, Da:	7.69
IP(EA), eV:	-9.34(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-(1H-imidazol-5-ylmethyl)-4-thiophen-2-ylbutanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)C(=O)N[C@H]2COC[C@H]2CS(=O)(=O)N(C)C)C

DOS

IR

Vibrations