Geometry & MOs

Info

ID:	439351
PubChem CID:	135229122
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	-30.16
Dipole, Da:	3.65
IP(EA), eV:	-8.9(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCC[C@@H](CCO)NC1=NC(=NC=C1OCC2=NC3=CC=CC=C3C=C2)CC

DOS

IR

Vibrations