Geometry & MOs

Info

ID:	288015
PubChem CID:	104307587
Reduced:	BrNOC18H20 (1)
Stoich.:	ABCD18E20 (1)
Weight, g/mol:	311.05209
ΔH_f, kcal/mol:	-27.61
Dipole, Da:	5.53
IP(EA), eV:	-8.86(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-bromopropyl)phenyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)NC2=CC=CC(=C2)CCCBr)C

DOS

IR

Vibrations