Geometry & MOs

Info

ID:	357751
PubChem CID:	127294464
Reduced:	O2N5C19H31 (1)
Stoich.:	A2B5C19D31 (1)
Weight, g/mol:	361.247775
ΔH_f, kcal/mol:	-70.56
Dipole, Da:	3.58
IP(EA), eV:	-8.79(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-morpholin-4-ylpyridin-4-yl)methyl]-3-(1-propylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)NC(=O)NCC2=C(N=CC=C2)N3CCOCC3

DOS

IR

Vibrations