Geometry & MOs

Info

ID:	364782
PubChem CID:	127316120
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	355.200825
ΔH_f, kcal/mol:	-70.73
Dipole, Da:	6.55
IP(EA), eV:	-9.12(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]-(2-morpholin-4-ylphenyl)methanone

Drug info:

PubChemData

Smile

CCC(=O)N1CCCCC1C(=O)N2CCN(CC2)CC3=NC=CN3

DOS

IR

Vibrations