Geometry & MOs

Info

ID:	353987
PubChem CID:	127285644
Reduced:	O2N5C20H31 (1)
Stoich.:	A2B5C20D31 (1)
Weight, g/mol:	350.214033
ΔH_f, kcal/mol:	-84.13
Dipole, Da:	5.51
IP(EA), eV:	-9.24(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]-3-[1-(cyclopropylmethyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)NC2CCN(CC2)CC3=CC=NC=C3

DOS

IR

Vibrations