Geometry & MOs

Info

ID:	350299
PubChem CID:	127277377
Reduced:	O2N3C24H29 (1)
Stoich.:	A2B3C24D29 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-67.61
Dipole, Da:	3.9
IP(EA), eV:	-8.61(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)-3-[[1-(1-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methyl]urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)NCC2CCCN(C2)C(=O)C3=CC=CC4=C3CCC4

DOS

IR

Vibrations