Geometry & MOs

Info

ID:	147108
PubChem CID:	53786761
Reduced:	NO2C25H29 (1)
Stoich.:	AB2C25D29 (1)
Weight, g/mol:	199.168462
ΔH_f, kcal/mol:	-43.81
Dipole, Da:	2.85
IP(EA), eV:	-8.45(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(4-pyrrolidin-1-ylbutyl)urea

Drug info:

PubChemData

Smile

CCCOC1=CC2=C(C=C1)C=C(C=C2)C3(CCN(CC3)CC4=CC=CC=C4)O

DOS

IR

Vibrations