Geometry & MOs

Info

ID:	357281
PubChem CID:	127293914
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-121.36
Dipole, Da:	3.22
IP(EA), eV:	-8.78(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-chromen-6-yl)-3-(1-phenylpyrrolidin-3-yl)urea

Drug info:

PubChemData

Smile

CN(C1CCOC1)C(=O)NC2=CC=CC(=C2)CN3CCCCC3=O

DOS

IR

Vibrations