Geometry & MOs

Info

ID:	53442
PubChem CID:	14716000
Reduced:	O3H18C22 (1)
Stoich.:	A3B18C22 (1)
Weight, g/mol:	191.131014
ΔH_f, kcal/mol:	-54.31
Dipole, Da:	6.58
IP(EA), eV:	-9.23(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(but-3-enylamino)-2-phenylethanol

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC=CC=C4)O

DOS

IR

Vibrations