Geometry & MOs

Info

ID:	164289
PubChem CID:	74382732
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	348.241293
ΔH_f, kcal/mol:	-21.06
Dipole, Da:	0.89
IP(EA), eV:	-8.72(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-2-piperidin-1-ylpentyl) 4-amino-2-ethoxybenzoate

Drug info:

PubChemData

Smile

CC1=CC2=C3C(C=NN3CC(=O)NCCN(C)C4CCCCC4)C(=O)N=C2C=C1

DOS

IR

Vibrations