Geometry & MOs

Info

ID:	264504
PubChem CID:	103464825
Reduced:	N3C13H19 (1)
Stoich.:	A3B13C19 (1)
Weight, g/mol:	199.157229
ΔH_f, kcal/mol:	20.93
Dipole, Da:	4.56
IP(EA), eV:	-8.07(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylbutyl)-4-(hydroxymethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCC(C)(C)CN1C=NC2=C1C=CC(=C2)N

DOS

IR

Vibrations