Geometry & MOs

Info

ID:	188562
PubChem CID:	77734396
Reduced:	O2N5C18H23 (1)
Stoich.:	A2B5C18D23 (1)
Weight, g/mol:	484.351237
ΔH_f, kcal/mol:	-26.93
Dipole, Da:	4.89
IP(EA), eV:	-9.54(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ditert-butyl 5-(2-hydroxypentyl)-4-prop-1-enylpyrrolidine-1,2-dicarboxylate;N-ethylacetamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CNC2CCN(CC2)C(=O)C3=CN=CC=C3)C#N

DOS

IR

Vibrations