Geometry & MOs

Info

ID:	173042
PubChem CID:	75588947
Reduced:	N3C11H12 (2)
Stoich.:	A3B11C12 (2)
Weight, g/mol:	302.199428
ΔH_f, kcal/mol:	115.73
Dipole, Da:	7.48
IP(EA), eV:	-8.68(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpyrrolidin-3-yl)-1-(methoxymethyl)cyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CC(NN1)C2=C(N=CN2CC3=CN4C(=CC=CC4=N3)C)C5=CC=CC=C5

DOS

IR

Vibrations