Geometry & MOs

Info

ID:	383737
PubChem CID:	134975625
Reduced:	BrNOC12H12 (1)
Stoich.:	ABCD12E12 (1)
Weight, g/mol:	241.01023
ΔH_f, kcal/mol:	33.11
Dipole, Da:	4.3
IP(EA), eV:	-9.95(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(3-bromopropoxy)-1-phenylmethanimine

Drug info:

PubChemData

Smile

CC(C)C1C(O1)(C#N)C2=CC(=CC=C2)Br

DOS

IR

Vibrations