Geometry & MOs

Info

ID:	393179
PubChem CID:	135019632
Reduced:	NO2F4C9H11 (1)
Stoich.:	AB2C4D9E11 (1)
Weight, g/mol:	185.120449
ΔH_f, kcal/mol:	-308.74
Dipole, Da:	2.15
IP(EA), eV:	-10.45(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl(cyclopenta-1,4-dien-1-ylmethyl)azanium

Drug info:

PubChemData

Smile

CC1CN2C(=O)CCC2(C(C1(F)F)(F)F)O

DOS

IR

Vibrations