Geometry & MOs

Info

ID:	362698
PubChem CID:	127309132
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	331.225977
ΔH_f, kcal/mol:	-10.66
Dipole, Da:	4.22
IP(EA), eV:	-8.93(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-3-(5-methyl-2,3-dihydro-1H-inden-1-yl)urea

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(CC2)NC(=O)N3CCCC(C3)N4C=C(C=N4)C

DOS

IR

Vibrations