Geometry & MOs

Info

ID:	198806
PubChem CID:	79154397
Reduced:	ON3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	215.199762
ΔH_f, kcal/mol:	-24.34
Dipole, Da:	4.63
IP(EA), eV:	-9.1(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(aminomethyl)pentan-3-yl]-1-ethyl-3,3-dimethylurea

Drug info:

PubChemData

Smile

CN(C)C(=O)NC(CN)C1=CC=CC=C1

DOS

IR

Vibrations