Geometry & MOs

Info

ID:	255506
PubChem CID:	103132562
Reduced:	N2C17H22 (1)
Stoich.:	A2B17C22 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	36.52
Dipole, Da:	2.25
IP(EA), eV:	-8.9(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-methyloxolan-2-yl)methoxymethyl]aniline

Drug info:

PubChemData

Smile

CC(C)NCC1CCC1C2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations