Geometry & MOs

Info

ID:	369191
PubChem CID:	127331493
Reduced:	O2N5C18H25 (1)
Stoich.:	A2B5C18D25 (1)
Weight, g/mol:	386.256943
ΔH_f, kcal/mol:	-6.11
Dipole, Da:	4.23
IP(EA), eV:	-9.69(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyloxan-3-yl)methyl]-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)C2=CC(=CC=C2)N3C=NN=N3

DOS

IR

Vibrations