Geometry & MOs

Info

ID:	367288
PubChem CID:	127324065
Reduced:	ON6C20H28 (1)
Stoich.:	AB6C20D28 (1)
Weight, g/mol:	343.225977
ΔH_f, kcal/mol:	4.52
Dipole, Da:	1.0
IP(EA), eV:	-7.82(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[(4-phenyloxan-4-yl)methyl]urea

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)NCC(C)N3CCC4=CC=CC=C43

DOS

IR

Vibrations