Geometry & MOs

Info

ID:	174382
PubChem CID:	75758307
Reduced:	N2O5C28H32 (1)
Stoich.:	A2B5C28D32 (1)
Weight, g/mol:	404.18667
ΔH_f, kcal/mol:	-150.82
Dipole, Da:	6.03
IP(EA), eV:	-8.58(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[(2-chloroacetyl)-[(5-methylfuran-2-yl)methyl]amino]-2-(2,4-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(C(C2=CC(=C(C=C2)O)OC)C(=O)NC3CCCCC3)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations