Geometry & MOs

Info

ID:	249788
PubChem CID:	103092096
Reduced:	NO2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	-48.54
Dipole, Da:	2.11
IP(EA), eV:	-8.24(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-cycloheptyl-N-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC(=C(C=C1)OC)O)NC

DOS

IR

Vibrations