Geometry & MOs

Info

ID:	414376
PubChem CID:	135087332
Reduced:	FNSO5C13H16 (1)
Stoich.:	ABCD5E13F16 (1)
Weight, g/mol:	350.150954
ΔH_f, kcal/mol:	-252.46
Dipole, Da:	8.72
IP(EA), eV:	-9.96(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[2-(dimethylamino)ethyl]-4-methoxy-N-[(5-methyl-1H-imidazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)S(=O)(=O)N2CC[C@H]([C@H](C2)C(=O)O)O

DOS

IR

Vibrations