Geometry & MOs

Info

ID:	240407
PubChem CID:	93578241
Reduced:	NO4C21H25 (1)
Stoich.:	AB4C21D25 (1)
Weight, g/mol:	393.230394
ΔH_f, kcal/mol:	-96.37
Dipole, Da:	2.14
IP(EA), eV:	-8.83(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[furan-2-ylmethyl-[(4-propan-2-ylphenyl)methyl]amino]-3-(3-methylphenoxy)propan-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC[C@H](CN(CC2=CC=CO2)CC3=CC=C(O3)C)O

DOS

IR

Vibrations