Geometry & MOs

Info

ID:	354563
PubChem CID:	127287177
Reduced:	N3O3C22H33 (1)
Stoich.:	A3B3C22D33 (1)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-117.52
Dipole, Da:	3.67
IP(EA), eV:	-8.35(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-4-cyclopropylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CNC(=O)N2CCN3CCCCC3C2)OC4CCCC4

DOS

IR

Vibrations