Geometry & MOs

Info

ID:	354462
PubChem CID:	127286906
Reduced:	O2N5C17H31 (1)
Stoich.:	A2B5C17D31 (1)
Weight, g/mol:	325.236542
ΔH_f, kcal/mol:	-50.92
Dipole, Da:	6.37
IP(EA), eV:	-8.28(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-2-ylmethyl)-3-[(4-pyrrolidin-1-yloxan-4-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CNC(=O)N(C)CCN(C)C2CCN(CC2)C

DOS

IR

Vibrations