Geometry & MOs

Info

ID:	382221
PubChem CID:	134973225
Reduced:	O7C16H24 (1)
Stoich.:	A7B16C24 (1)
Weight, g/mol:	273.115364
ΔH_f, kcal/mol:	-325.54
Dipole, Da:	2.81
IP(EA), eV:	-10.21(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(pyren-1-ylmethylamino)acetaldehyde

Drug info:

PubChemData

Smile

CC1(O[C@H]2[C@H](O[C@H]3[C@@H]([C@H]2O1)OC(O3)(C)C)[C@H]4CC=CC(O4)O)C

DOS

IR

Vibrations