Geometry & MOs

Info

ID:	149453
PubChem CID:	53789126
Reduced:	NO4C16H31 (1)
Stoich.:	AB4C16D31 (1)
Weight, g/mol:	389.267842
ΔH_f, kcal/mol:	-232.73
Dipole, Da:	2.21
IP(EA), eV:	-10.18(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[1-[4-[benzoyl(methyl)amino]butyl]pyrrolidin-3-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)OC

DOS

IR

Vibrations