Geometry & MOs

Info

ID:	222312
PubChem CID:	85296653
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	351.219829
ΔH_f, kcal/mol:	-43.85
Dipole, Da:	5.31
IP(EA), eV:	-9.09(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(benzylamino)-3-phenylmethoxypropylidene]cyclopentyl]methanol

Drug info:

PubChemData

Smile

CC1C(N(C(=O)N1C)C(=O)C(C)NCC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations