Geometry & MOs

Info

ID:	406720
PubChem CID:	135078447
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	210.125594
ΔH_f, kcal/mol:	30.53
Dipole, Da:	4.7
IP(EA), eV:	-8.78(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(E)-but-2-enoxy]cyclohexene-1-carboxylate

Drug info:

PubChemData

Smile

CCC1(N=C(N=CN1C(C)(C)C)C2=CC=CC=C2)C

DOS

IR

Vibrations