Geometry & MOs

Info

ID:	130865
PubChem CID:	51118881
Reduced:	O2N4H16C21 (1)
Stoich.:	A2B4C16D21 (1)
Weight, g/mol:	355.189592
ΔH_f, kcal/mol:	41.7
Dipole, Da:	4.32
IP(EA), eV:	-9.14(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(oxan-2-ylmethoxymethyl)phenyl]-3-(pyridin-2-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CN=CO4

DOS

IR

Vibrations