Geometry & MOs

Info

ID:	130032
PubChem CID:	51074693
Reduced:	N3O4C18H25 (1)
Stoich.:	A3B4C18D25 (1)
Weight, g/mol:	305.173942
ΔH_f, kcal/mol:	-153.05
Dipole, Da:	7.37
IP(EA), eV:	-8.78(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-pyrrolidin-1-ylethyl)urea

Drug info:

PubChemData

Smile

C1CCC(=O)N(CC1)CCCNC(=O)NCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations