Geometry & MOs

Info

ID:	391695
PubChem CID:	135008433
Reduced:	NO2C15H15 (1)
Stoich.:	AB2C15D15 (1)
Weight, g/mol:	257.177964
ΔH_f, kcal/mol:	-29.51
Dipole, Da:	7.8
IP(EA), eV:	-9.08(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-(4-methyl-2-propan-2-ylpyrrol-1-yl)-1-phenylpropan-1-ol

Drug info:

PubChemData

Smile

C=CCN1C=C(C=C1C2=CC=CC=C2)CC(=O)O

DOS

IR

Vibrations