Geometry & MOs

Info

ID:	64844
PubChem CID:	29204085
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-89.16
Dipole, Da:	7.51
IP(EA), eV:	-9.24(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3R,5S)-3,5-dimethylpiperidine-1-carbonyl]phenyl]methylurea

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)N)C

DOS

IR

Vibrations