Geometry & MOs

Info

ID:	332587
PubChem CID:	127250873
Reduced:	FO2N4C25H27 (1)
Stoich.:	AB2C4D25E27 (1)
Weight, g/mol:	446.231791
ΔH_f, kcal/mol:	-24.93
Dipole, Da:	4.4
IP(EA), eV:	-8.4(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[2-(4-methoxyphenoxy)ethyl]-1H-pyrazol-3-yl]-4-[(1-methylindol-3-yl)methyl]morpholine

Drug info:

PubChemData

Smile

CN1C=C(C2=C1C=CC(=C2)F)CN3CCOC(C3)C4=NNC(=C4)CCOC5=CC=CC=C5

DOS

IR

Vibrations