Geometry & MOs

Info

ID:	243016
PubChem CID:	99215070
Reduced:	O2N3C26H37 (1)
Stoich.:	A2B3C26D37 (1)
Weight, g/mol:	364.215078
ΔH_f, kcal/mol:	-62.41
Dipole, Da:	3.61
IP(EA), eV:	-8.36(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-cyanophenyl)methyl]-5-(4-methoxyphenyl)-N-propylpentanamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2=CC=CC=C2CNC(=O)CCCCC3=CC=C(C=C3)OC

DOS

IR

Vibrations