Geometry & MOs

Info

ID:	217248
PubChem CID:	85087501
Reduced:	N2O3C20H30 (1)
Stoich.:	A2B3C20D30 (1)
Weight, g/mol:	346.204513
ΔH_f, kcal/mol:	-160.52
Dipole, Da:	5.49
IP(EA), eV:	-9.28(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-hydroxy-1-phenylpropan-2-yl)-methylamino]-4-phenylhepta-2,6-dienenitrile

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2CC(CC2=O)(C)C(C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations