Geometry & MOs

Info

ID:	250030
PubChem CID:	103093698
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-29.53
Dipole, Da:	2.92
IP(EA), eV:	-8.52(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-4-[(E)-2-methyl-3-(propylamino)but-1-enyl]phenol

Drug info:

PubChemData

Smile

CCCNC(C)/C(=C/C1=CC=C(C=C1)OC)/C

DOS

IR

Vibrations