Geometry & MOs

Info

ID:	274161
PubChem CID:	103807439
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	270.173213
ΔH_f, kcal/mol:	-43.06
Dipole, Da:	3.03
IP(EA), eV:	-8.99(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1-aminoethyl)phenyl]tricyclo[3.2.1.02,4]octane-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=O)NC=C2)N

DOS

IR

Vibrations