Geometry & MOs

Info

ID:	435657
PubChem CID:	135192084
Reduced:	N3O3C23H31 (1)
Stoich.:	A3B3C23D31 (1)
Weight, g/mol:	173.120449
ΔH_f, kcal/mol:	-87.93
Dipole, Da:	3.98
IP(EA), eV:	-8.79(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenylbut-3-en-2-yl)ethanimine

Drug info:

PubChemData

Smile

C[C@@H]1CN=C(C=C(C1C)CC(C)C)C(=O)N[C@H]2COC3=CC=CC=C3N(C2=O)C

DOS

IR

Vibrations