Geometry & MOs

Info

ID:	43130
PubChem CID:	10318871
Reduced:	FO2N5C21H28 (1)
Stoich.:	AB2C5D21E28 (1)
Weight, g/mol:	401.220223
ΔH_f, kcal/mol:	-64.12
Dipole, Da:	3.45
IP(EA), eV:	-9.21(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dimethoxy-4-pentoxyphenyl)methyl]-N-[3-(hydroxymethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C(CN(CC12CCC2)C3=C(C=C4C(=C3C)N(C(=O)N(C4=O)N)C5CC5)F)N

DOS

IR

Vibrations