Geometry & MOs

Info

ID:	413276
PubChem CID:	135086223
Reduced:	NOC10H13 (1)
Stoich.:	ABC10D13 (1)
Weight, g/mol:	206.13068
ΔH_f, kcal/mol:	-10.27
Dipole, Da:	3.09
IP(EA), eV:	-9.31(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-2-(methoxymethyl)but-2-enoxy]methylbenzene

Drug info:

PubChemData

Smile

CC(C)C(=C)C(=O)N1C=CC=C1

DOS

IR

Vibrations