Geometry & MOs

Info

ID:	224458
PubChem CID:	85343300
Reduced:	N4O5C29H36 (1)
Stoich.:	A4B5C29D36 (1)
Weight, g/mol:	527.282429
ΔH_f, kcal/mol:	-125.91
Dipole, Da:	5.76
IP(EA), eV:	-8.72(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dibenzylamino)-4-trityloxybutan-1-ol

Drug info:

PubChemData

Smile

CC1CC2C3CCC4=CC5=C(CC4(C3C(CC2(C16C7(COCO7)OCO6)C)O)C)C=NN5C8=NC=CC=N8

DOS

IR

Vibrations