Geometry & MOs

Info

ID:	252338
PubChem CID:	103110644
Reduced:	O2N4C11H22 (1)
Stoich.:	A2B4C11D22 (1)
Weight, g/mol:	221.152812
ΔH_f, kcal/mol:	-98.54
Dipole, Da:	5.43
IP(EA), eV:	-8.89(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-amino-2-methylphenyl)methyl]-3-propylurea

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C1CNCCN1

DOS

IR

Vibrations