Geometry & MOs

Info

ID:	300511
PubChem CID:	121360358
Reduced:	NO3C11H13 (3)
Stoich.:	AB3C11D13 (3)
Weight, g/mol:	276.162649
ΔH_f, kcal/mol:	-358.74
Dipole, Da:	9.78
IP(EA), eV:	-8.81(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethylidene-N'-[(E)-2-phenylbut-1-enyl]benzenecarboximidamide

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC(=C1)C(=O)OC)NC(=O)C2=C(C(=C(C=C2)NC(=O)C3=CC=C(C=C3)NC(=O)OC(C)(C)C)OC(C)C)O

DOS

IR

Vibrations