Geometry & MOs

Info

ID:	198530
PubChem CID:	79114589
Reduced:	ON3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	254.03063
ΔH_f, kcal/mol:	-47.14
Dipole, Da:	3.57
IP(EA), eV:	-8.68(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-4-(pent-4-enoxymethyl)benzene

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)NC(=O)CN(C)C2CCC(CC2)N

DOS

IR

Vibrations