Geometry & MOs

Info

ID:	443140
PubChem CID:	135257837
Reduced:	SN3O3F5H32C36 (1)
Stoich.:	AB3C3D5E32F36 (1)
Weight, g/mol:	485.267842
ΔH_f, kcal/mol:	-196.6
Dipole, Da:	4.26
IP(EA), eV:	-9.01(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-cyclopentylphenyl)methyl-[2-(ethylamino)acetyl]amino]-N-phenylmethoxybenzamide

Drug info:

PubChemData

Smile

C1CCC(C1)C2=CC=C(C=C2)CN(C3=CC=C(C=C3)C(=O)NOCC4=CC=CC=C4)C(=O)[C@H]5CCN5SC6=C(C(=C(C(=C6F)F)F)F)F

DOS

IR

Vibrations